Vitas-M small molecule compound

5-[(2E)-2-(3-fluorobenzylidene)hydrazinyl]-7H-[1,2,4]triazolo[1,5-d][1,2,4]triazepin-8(9H)-imine

Catalog ID
STL438242
SMILES N=C1NN=C(n2c(C1)ncn2)N/N=C/c1cccc(c1)F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H11FN8 MW 286.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11FN8/c13-9-3-1-2-8(4-9)6-16-19-12-20-18-10(14)5-11-15-7-17-21(11)12/h1-4,6-7H,5H2,(H2,14,18)(H,19,20)/b16-6+
InChIKey
DMDURWDOGDMEQC-OMCISZLKSA-N
Synonyms

5((2E)2(3fluorobenzylidene)hydrazinyl)7H(124)triazolo(15d)(124)triazepin8(9H)imine
5N((E)(3fluorophenyl)methylideneamino)9H(124)triazolo(15d)(124)triazepine58diamine
C1C(=NN=C(N2C1=NC=N2)NN=CC3=CC(=CC=C3)F)N
InChI=1SC12H11FN8c1393128(49)6161912201810(14)5111571721(11)12h1467H5H2(H21418)(H1920)b166+
MFCD06244655
N=C1NN=C(n2c(C1)ncn2)NN=Cc1cccc(c1)F
ZINC000003772475
ZINC101389487

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Available files

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